4-azanyl-2-[2-(2,5-dimethylthiophen-3-yl)-2-oxidanylidene-ethyl]sulfanyl-pyrimidine-5-carbonitrile

Systemtic Name: 4-azanyl-2-[2-(2,5-dimethylthiophen-3-yl)-2-oxidanylidene-ethyl]sulfanyl-pyrimidine-5-carbonitrile Openeye Name: 4-amino-2-[2-(2,5-dimethyl-3-thienyl)-2-oxo-ethyl]sulfanyl-pyrimidine-5-carbonitrile CAS Name: 4-amino-2-[[2-(2,5-dimethyl-3-thiophenyl)-2-oxoethyl]thio]-5-pyrimidinecarbonitrile IUPAC Name: 4-amino-2-[2-(2,5-dimethylthiophen-3-yl)-2-oxoethyl]sulfanylpyrimidine-5-carbonitrile Traditional Name: 4-amino-2-[[2-(2,5-dimethyl-3-thienyl)-2-keto-ethyl]thio]pyrimidine-5-carbonitrile Formula: C13H12N4OS2 MolecularWeight: 304.39058

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)C)C(=O)CSC2=NC=C(C(=N2)N)C#N

Isomeric SMILES

CC1=CC(=C(S1)C)C(=O)CSC2=NC=C(C(=N2)N)C#N

InChI

InChI=1S/C13H12N4OS2/c1-7-3-10(8(2)20-7)11(18)6-19-13-16-5-9(4-14)12(15)17-13/h3,5H,6H2,1-2H3,(H2,15,16,17)